| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2010 | 20 | No |
Popular Name: 2-[methyl-[[(2S)-tetrahydrofuran-2-yl]methyl]amino]-1-(3-nitrophenyl)ethanone 2-[methyl-[[(2S)-tetrahydrofuran…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 1.80 | 8.2 | -55.06 | 1 | 6 | 1 | 77 | 279.316 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.80 | 5.85 | -17.1 | 0 | 6 | 0 | 75 | 278.308 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
